3-[3-[5-(pyridin-3-ylmethylcarbamoyl)benzimidazol-1-yl]phenoxy]pentan-3-yl ethanoate

Systemtic Name: 3-[3-[5-(pyridin-3-ylmethylcarbamoyl)benzimidazol-1-yl]phenoxy]pentan-3-yl ethanoate Openeye Name: [1-ethyl-1-[3-[5-(3-pyridylmethylcarbamoyl)benzimidazol-1-yl]phenoxy]propyl] acetate CAS Name: acetic acid 3-[3-[5-[oxo-(3-pyridinylmethylamino)methyl]-1-benzimidazolyl]phenoxy]pentan-3-yl ester IUPAC Name: 3-[3-[5-(pyridin-3-ylmethylcarbamoyl)benzimidazol-1-yl]phenoxy]pentan-3-yl acetate Traditional Name: acetic acid [1-ethyl-1-[3-[5-(3-pyridylmethylcarbamoyl)benzimidazol-1-yl]phenoxy]propyl] ester Formula: C27H28N4O4 MolecularWeight: 472.53562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(OC1=CC=CC(=C1)N2C=NC3=C2C=CC(=C3)C(=O)NCC4=CN=CC=C4)OC(=O)C

Isomeric SMILES

CCC(CC)(OC1=CC=CC(=C1)N2C=NC3=C2C=CC(=C3)C(=O)NCC4=CN=CC=C4)OC(=O)C

InChI

InChI=1S/C27H28N4O4/c1-4-27(5-2,34-19(3)32)35-23-10-6-9-22(15-23)31-18-30-24-14-21(11-12-25(24)31)26(33)29-17-20-8-7-13-28-16-20/h6-16,18H,4-5,17H2,1-3H3,(H,29,33)